N-[(3,4-Dimethoxyphenyl)methylidene]hydroxylamine
Basic information
- CAS
2169-98-4- Standard SMILES
COc1ccc(C=NO)cc1OC- InChIKey
LHZIVRAMZJJLAP-UHFFFAOYSA-N- Molecular formula
- C9H11NO3
- Average molar mass
- 181.19 g/mol
- Monoisotopic mass
- 181.07389321
Names & identifiers
- Preferred name
- N-[(3,4-Dimethoxyphenyl)methylidene]hydroxylamine
- IUPAC
- N-[(3,4-dimethoxyphenyl)methylidene]hydroxylamine
- English name
- 3,4-Dimethoxy-benzaldoxim
- Molecular formula
- C9H11NO3
- Molecular weight
- 181.19
Names & synonyms
N-[(3,4-dimethoxyphenyl)methylidene]hydroxylamineDTXSID80944296N-((3,4-dimethoxyphenyl)methylidene)hydroxylamineRefChem:828800DTXCID801372644839-653-9Benzaldehyde,3,4-dimethoxy-, oxime(3,4-dimethoxyphenyl)(hydroxyimino)methaneSCHEMBL2165442LHZIVRAMZJJLAP-UHFFFAOYSA-NAKOS017263791(3,4-dimethoxyphenyl)hydroxyiminomethane
Show more names
Nsc27025VERATRALDEHYDE OXIME3,4-Dimethoxy-benzaldoximBenzaldehyde, 3,4-dimethoxy-, oxime(1E)-3,4-dimethoxybenzaldehyde oxime
D6625
Database identifiers
- CAS
2169-98-4- PubChem CID
- 16577
- DTXSID
DTXSID80944296
Properties
Computed structural properties
- XLogP
- 1.8
- Topological polar surface area
- 51.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 172
Physicochemical properties
- FDA UNII
- 8 M2WPJ5 · AGF8M2WPJ5
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 315 · H315-H302-H319-H335
- Precautionary statements
- 264 · P264-P270-P301+P312-P330-P501-P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
Warning
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H315-H302-H319-H335
- Precautionary statements
- P264-P270-P301+P312-P330-P501-P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P
Related reactions
3 records
Compound notes
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